PUBCHEM-ZINC05851021 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.5370 3.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 3.4710 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 3.0240 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 3.4530 4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 2.5360 5.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 2.9600 6.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 4.3260 7.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 5.2530 6.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 4.8100 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 6.5020 6.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 7.3520 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 6.3120 7.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 5.0310 8.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 7.3870 8.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 8.7250 8.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 9.7280 9.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 9.4260 10.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 8.0890 10.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 7.0690 9.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 5.7720 10.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 5.2360 11.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 8.1190 11.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 7.3520 12.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 9.4230 12.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 10.1870 11.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 9.9110 13.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0280 8.7940 14.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 11.0220 8.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 11.2580 7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.5140 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.0030 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 1.0920 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 1.2160 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 4.5590 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 3.0480 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 3.3460 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 3.4700 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 1.4800 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 2.2410 7.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 5.5190 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 8.9640 7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 5.2910 10.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 5.8110 11.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 4.1960 11.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 10.5740 14.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5810 10.4540 13.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 9.0350 15.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 10.7510 6.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 12.3290 7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 10.8730 7.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 3.0020 3.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 56 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 56 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 57 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 6 57 1 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END